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- W1972175538 abstract "Some calculations are presented using a recently developed version of the ab initio polarizable continuum model that includes electron correlation in the representation of the solute. Calculations were carried out to estimate the self-consistent field electronic solvation energies and one-electron properties of several molecules. Comparison is made of results at several levels of approximation." @default.
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- W1972175538 date "1993-02-01" @default.
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- W1972175538 title "Polarizable continuum model calculations including electron correlation in the ab initio wavefunction" @default.
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- W1972175538 doi "https://doi.org/10.1016/0166-1280(93)90070-r" @default.
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